A DFT study on mechanisms of CO 2 coupling with propargylic alcohols using alkali carbonates-Reference-Cited by-同舟云学术

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A DFT study on mechanisms of CO 2 coupling with propargylic alcohols using alkali carbonates

Published:2019-12-20 Issue:8 Volume:120 Page:
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int J Quantum Chem

Author:

Li Weiyi¹^ORCID,Leng Geng²,Li Caiqin³,Lyu Yajing¹

Affiliation:

1. School of Science, Research Center for Advanced ComputationXihua University Chengdu Sichuan People's Republic of China

2. School of Resources and EnvironmentUniversity of Electronic Science and Technology of China Chengdu People's Republic of China

3. School of Chemistry and Chemical EngineeringShanxi Datong University Datong People's Republic of China

Funder

Fundamental Research Funds for the Central Universities

National Natural Science Foundation of China

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/qua.26150

Reference100 articles.

1. Conversion of CO2 to value-added products mediated by ionic liquids

2. The Use of Carbon Dioxide (CO2) as a Building Block in Organic Synthesis from an Industrial Perspective

3. Nanocellulose, a Versatile Green Platform: From Biosources to Materials and Their Applications

4. Efficient, selective and sustainable catalysis of carbon dioxide

5. Recent advances in organic synthesis with CO2 as C1 synthon

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1. Theory study on catalytic hydrogenation of CO₂ to formic acid over Si, N‐doped modified graphene quantum dots supported single atom Fe;International Journal of Quantum Chemistry;2024-05-30

2. The tandem reaction of propargylamine/propargyl alcohol with CO2: Reaction mechanism, catalyst activity and product diversity;Journal of CO2 Utilization;2022-11

3. Substituent effects and mechanism studies in CO 2 transformation to benzoxazinone derivatives as worthwhile N‐containing heterocycles: Insight from Density functional theory;International Journal of Quantum Chemistry;2021-07-27

4. Theoretical designing and understanding of the performances of BH bridged organocatalysts by π‐conjugated molecules in CO 2 hydroboration;International Journal of Quantum Chemistry;2020-10-27

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